(3aS,7R,7aS)-2-[[2-[[(3S)-3-Amino-6-[[(3S)-3-amino-6-[[(3S)-3,6-diamino-1-oxohexyl]amino]-1-oxohexyl]amino]-1-oxohexyl]amino]-4-O-(aminocarbonyl)-2-deoxy-β-D-gulopyranosyl]amino]-1,3a,5,6,7,7a-hexahydro-7-hydroxy-4H-imidazo[4,5-c]pyridin-4-one

CAS Registry Number®

3776-37-2

CAS Name

(3aS,7R,7aS)-2-[[2-[[(3S)-3-Amino-6-[[(3S)-3-amino-6-[[(3S)-3,6-diamino-1-oxohexyl]amino]-1-oxohexyl]amino]-1-oxohexyl]amino]-4-O-(aminocarbonyl)-2-deoxy-β-D-gulopyranosyl]amino]-1,3a,5,6,7,7a-hexahydro-7-hydroxy-4H-imidazo[4,5-c]pyridin-4-one

Molecular Formula

C31H58N12O10

Molecular Mass

758.87

Cite this Page

(3aS,7R,7aS)-2-[[2-[[(3S)-3-Amino-6-[[(3S)-3-amino-6-[[(3S)-3,6-diamino-1-oxohexyl]amino]-1-oxohexyl]amino]-1-oxohexyl]amino]-4-O-(aminocarbonyl)-2-deoxy-β-D-gulopyranosyl]amino]-1,3a,5,6,7,7a-hexahydro-7-hydroxy-4H-imidazo[4,5-c]pyridin-4-one.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=3776-37-2 (retrieved 2024-11-08) (CAS RN: 3776-37-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C31H58N12O10/c32-7-1-4-15(33)10-20(46)37-8-2-5-16(34)11-21(47)38-9-3-6-17(35)12-22(48)40-25-26(49)27(53-30(36)51)19(14-44)52-29(25)43-31-41-23-18(45)13-39-28(50)24(23)42-31/h15-19,23-27,29,44-45,49H,1-14,32-35H2,(H2,36,51)(H,37,46)(H,38,47)(H,39,50)(H,40,48)(H2,41,42,43)/t15-,16-,17-,18+,19+,23+,24-,25+,26-,27-,29+/m0/s1

InChIKey

InChIKey=WUJTXMVGXDQPNN-OTQKCRDJSA-N

SMILES

N([C@H]1[C@H](NC(C[C@H](CCCNC(C[C@H](CCCNC(C[C@H](CCCN)N)=O)N)=O)N)=O)[C@H](O)[C@@H](OC(N)=O)[C@@H](CO)O1)C=2N[C@]3([C@](N2)(C(=O)NC[C@H]3O)[H])[H]

Canonical SMILES

O=C(OC1C(O)C(NC(=O)CC(N)CCCNC(=O)CC(N)CCCNC(=O)CC(N)CCCN)C(OC1CO)NC2=NC3C(=O)NCC(O)C3N2)N

Other Names for this Substance

  • 4H-Imidazo[4,5-c]pyridin-4-one, 2-[[2-[[(3S)-3-amino-6-[[(3S)-3-amino-6-[[(3S)-3,6-diamino-1-oxohexyl]amino]-1-oxohexyl]amino]-1-oxohexyl]amino]-4-O-(aminocarbonyl)-2-deoxy-β-D-gulopyranosyl]amino]-1,3a,5,6,7,7a-hexahydro-7-hydroxy-, (3aS,7R,7aS)-
  • 4H-Imidazo[4,5-c]pyridin-4-one, 2-[[2-[3-amino-6-[3-amino-6-(3,6-diaminohexanamido)hexanamido]hexanamido]-2-deoxy-α-D-gulopyranosyl]amino]-3,3a,5,6,7,7a-hexahydro-7-hydroxy-, 6′-carbamate
  • Streptothricin D
  • 4H-Imidazo[4,5-c]pyridin-4-one, 2-[[2-[[3-amino-6-[[3-amino-6-[(3,6-diamino-1-oxohexyl)amino]-1-oxohexyl]amino]-1-oxohexyl]amino]-4-O-(aminocarbonyl)-2-deoxy-.β.-D-gulopyranosyl]amino]-1,3a,5,6,7,7a-hexahydro-7-hydroxy-, [3aS-[2[R*[R*(R*)]],3aα,7α,7aβ]]-
  • Racemomycin B

View All

Deleted or Replaced CAS Registry Numbers

11112-55-3, 38057-16-8

CAS INSIGHTSTM
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