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Aurasperone C

CAS Registry Number®

41689-66-1
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CAS Name

Aurasperone C

Molecular Formula

C31H28O12

Molecular Mass

592.55

Cite this Page

Aurasperone C.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=41689-66-1 (retrieved 2024-09-20) (CAS RN: 41689-66-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C31H28O12/c1-30(37)10-16(33)23-19(42-30)7-12-6-15(32)24(28(41-5)20(12)26(23)35)22-14-8-13(39-3)9-18(40-4)21(14)27(36)25-17(34)11-31(2,38)43-29(22)25/h6-9,32,35-38H,10-11H2,1-5H3

InChIKey

InChIKey=BAIJEJFONPISHA-UHFFFAOYSA-N

SMILES

O(C)C1=C(C=2C3=C(C(O)=C4C2OC(C)(O)CC4=O)C(OC)=CC(OC)=C3)C(O)=CC5=C1C(O)=C6C(=C5)OC(C)(O)CC6=O

Canonical SMILES

O=C1C=2C(O)=C3C(OC)=C(C(O)=CC3=CC2OC(O)(C)C1)C4=C5OC(O)(C)CC(=O)C5=C(O)C=6C(OC)=CC(OC)=CC64

Other Names for this Substance

  • [7,10′-Bi-4H-naphtho[2,3-b]pyran]-4,4′-dione, 2,2′,3,3′-tetrahydro-2,2′,5,5′,8-pentahydroxy-6,6′,8′-trimethoxy-2,2′-dimethyl-
  • 4H-Naphtho[2,3-b]pyran, bimol. deriv.
  • 2,2′,3,3′-Tetrahydro-2,2′,5,5′,8-pentahydroxy-6,6′,8′-trimethoxy-2,2′-dimethyl[7,10′-bi-4H-naphtho[2,3-b]pyran]-4,4′-dione
  • Aurasperone C