Fumitremorgin A

CAS Registry Number®

12626-18-5

CAS Name

Fumitremorgin A

Molecular Formula

C32H41N3O7

Molecular Mass

579.68

Cite this Page

Fumitremorgin A.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=12626-18-5 (retrieved 2024-11-22) (CAS RN: 12626-18-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C32H41N3O7/c1-18(2)12-14-40-28-26-21-11-10-20(39-7)16-23(21)34-25(15-19(3)4)41-42-31(5,6)17-24(27(26)34)35-29(36)22-9-8-13-33(22)30(37)32(28,35)38/h10-12,15-16,22,24-25,28,38H,8-9,13-14,17H2,1-7H3/t22-,24-,25+,28-,32+/m0/s1

InChIKey

InChIKey=ACGHJVZDNQZJOV-BMOJZYMJSA-N

SMILES

O(CC=C(C)C)[C@H]1C2=C3N(C=4C2=CC=C(OC)C4)[C@@H](C=C(C)C)OOC(C)(C)C[C@@]3(N5[C@]1(O)C(=O)N6[C@](C5=O)(CCC6)[H])[H]

Canonical SMILES

O=C1N2C3C4=C(C=5C=CC(OC)=CC5N4C(OOC(C)(C)C3)C=C(C)C)C(OCC=C(C)C)C2(O)C(=O)N6CCCC16

Other Names for this Substance

  • 5H,12H-3,4-Dioxa-5a,11a,15a-triazacyclooct[lm]indeno[5,6-b]fluorene-11,15(2H,13H)-dione, 1,10,10a,14,14a,15b-hexahydro-10a-hydroxy-7-methoxy-2,2-dimethyl-10-[(3-methyl-2-buten-1-yl)oxy]-5-(2-methyl-1-propen-1-yl)-, (5R,10S,10aR,14aS,15bS)-
  • 5H,12H-3,4-Dioxa-5a,11a,15a-triazacyclooct[lm]indeno[5,6-b]fluorene-11,15(2H,13H)-dione, 1,10,10a,14,14a,15b-hexahydro-10a-hydroxy-7-methoxy-2,2-dimethyl-10-[(3-methyl-2-butenyl)oxy]-5-(2-methyl-1-propenyl)-, [5R-(5α,10α,10aα,14aα,15bα)]-
  • 5H,12H-3,4-Dioxa-5a,11a,15a-triazacyclooct[lm]indeno[5,6-b]fluorene-11,15(2H,13H)-dione, 1,10,10a,14,14a,15b-hexahydro-10a-hydroxy-7-methoxy-2,2-dimethyl-10-[(3-methyl-2-butenyl)oxy]-5-(2-methyl-1-propenyl)-, (5R,10S,10aR,14aS,15bS)-
  • (5R,10S,10aR,14aS,15bS)-1,10,10a,14,14a,15b-Hexahydro-10a-hydroxy-7-methoxy-2,2-dimethyl-10-[(3-methyl-2-buten-1-yl)oxy]-5-(2-methyl-1-propen-1-yl)-5H,12H-3,4-dioxa-5a,11a,15a-triazacyclooct[lm]indeno[5,6-b]fluorene-11,15(2H,13H)-dione
  • Fumitremorgin A

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