(2R,3S)-2-(3,4-Dihydroxyphenyl)-8-[(1R,2S)-1-(3,4-dihydroxyphenyl)-2-hydroxy-3-(2,4,6-trihydroxyphenyl)propyl]-3,4-dihydro-2H-1-benzopyran-3,5,7-triol

CAS Registry Number®

76250-49-2

CAS Name

(2R,3S)-2-(3,4-Dihydroxyphenyl)-8-[(1R,2S)-1-(3,4-dihydroxyphenyl)-2-hydroxy-3-(2,4,6-trihydroxyphenyl)propyl]-3,4-dihydro-2H-1-benzopyran-3,5,7-triol

Molecular Formula

C30H28O12

Molecular Mass

580.54

Cite this Page

(2R,3S)-2-(3,4-Dihydroxyphenyl)-8-[(1R,2S)-1-(3,4-dihydroxyphenyl)-2-hydroxy-3-(2,4,6-trihydroxyphenyl)propyl]-3,4-dihydro-2H-1-benzopyran-3,5,7-triol.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=76250-49-2 (retrieved 2024-12-23) (CAS RN: 76250-49-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C30H28O12/c31-14-7-19(34)15(20(35)8-14)9-24(39)27(12-1-3-17(32)22(37)5-12)28-25(40)11-21(36)16-10-26(41)29(42-30(16)28)13-2-4-18(33)23(38)6-13/h1-8,11,24,26-27,29,31-41H,9-10H2/t24-,26-,27-,29+/m0/s1

InChIKey

InChIKey=AAOPKIFUFWCDQZ-KEQINOFFSA-N

SMILES

[C@H]([C@H](CC1=C(O)C=C(O)C=C1O)O)(C2=C3C(C[C@H](O)[C@H](O3)C4=CC(O)=C(O)C=C4)=C(O)C=C2O)C5=CC(O)=C(O)C=C5

Canonical SMILES

OC=1C=C(O)C(=C(O)C1)CC(O)C(C2=CC=C(O)C(O)=C2)C=3C(O)=CC(O)=C4C3OC(C5=CC=C(O)C(O)=C5)C(O)C4

Other Names for this Substance

  • 2H-1-Benzopyran-3,5,7-triol, 2-(3,4-dihydroxyphenyl)-8-[(1R,2S)-1-(3,4-dihydroxyphenyl)-2-hydroxy-3-(2,4,6-trihydroxyphenyl)propyl]-3,4-dihydro-, (2R,3S)-
  • (2R,3S)-2-(3,4-Dihydroxyphenyl)-8-[(1R,2S)-1-(3,4-dihydroxyphenyl)-2-hydroxy-3-(2,4,6-trihydroxyphenyl)propyl]-3,4-dihydro-2H-1-benzopyran-3,5,7-triol
  • Gambiriin A1

CAS INSIGHTSTM
Pile of blue, green, and white color of capsule pills with modern design light.