Guajavin B

CAS Registry Number®

145826-23-9

CAS Name

Guajavin B

Molecular Formula

C56H38O32

Molecular Mass

1222.88

Cite this Page

Guajavin B.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=145826-23-9 (retrieved 2024-11-05) (CAS RN: 145826-23-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C56H38O32/c57-14-7-21-10(3-20(63)48(84-21)9-1-15(58)35(65)16(59)2-9)34(64)26(14)31-30-33-29(44(74)47(77)45(30)75)28-32-27(42(72)46(76)43(28)73)25-13(6-19(62)38(68)41(25)71)53(79)85-22-8-83-52(78)11-4-17(60)36(66)39(69)23(11)24-12(5-18(61)37(67)40(24)70)54(80)86-49(22)51(88-56(32)82)50(31)87-55(33)81/h1-2,4-7,20,22,31,48-51,57-77H,3,8H2

InChIKey

InChIKey=YRBMKGMWALNDRF-UHFFFAOYSA-N

SMILES

OC=1C=2C(C3C4C5C(OC(=O)C=6C(C7=C(C(C(C2C(=O)O3)=C(O)C1O)=C(O)C(O)=C7O)C(=O)O4)=C(O)C(O)=C(O)C6)COC(=O)C=8C(C=9C(C(=O)O5)=CC(O)=C(O)C9O)=C(O)C(O)=C(O)C8)C=%10C(O)=C%11C(=CC%10O)OC(C(O)C%11)C%12=CC(O)=C(O)C(O)=C%12

Canonical SMILES

O=C1OCC2OC(=O)C3=CC(O)=C(O)C(O)=C3C4=C(O)C(O)=C(O)C5=C4C(=O)OC(C6OC(=O)C7=C5C(O)=C(O)C(O)=C7C6C8=C(O)C=C9OC(C%10=CC(O)=C(O)C(O)=C%10)C(O)CC9=C8O)C2OC(=O)C%11=CC(O)=C(O)C(O)=C%11C%12=C(O)C(O)=C(O)C=C1%12

Other Names for this Substance

  • Guajavin B
  • Vescalagin, 33-deoxy-33-[3,4-dihydro-3,5,7-trihydroxy-2-(3,4,5-trihydroxyphenyl)-2H-1-benzopyran-6-yl]-, stereoisomer

CAS INSIGHTSTM
Abstract Background of Blurry Golden Particles