Protohypericin

CAS Registry Number®

548-03-8

CAS Name

Protohypericin

Molecular Formula

C30H18O8

Molecular Mass

506.46

Cite this Page

Protohypericin.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=548-03-8 (retrieved 2024-11-12) (CAS RN: 548-03-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C30H18O8/c1-9-3-11-19(13(31)5-9)29(37)25-17(35)7-15(33)23-24-16(34)8-18(36)26-28(24)22(21(11)27(23)25)12-4-10(2)6-14(32)20(12)30(26)38/h3-8,31-36H,1-2H3

InChIKey

InChIKey=YLILOANQCQKPOD-UHFFFAOYSA-N

SMILES

OC=1C=2C3=C(C4=C5C2C(O)=CC(O)=C5C(=O)C=6C4=CC(C)=CC6O)C=7C(C(=O)C3=C(O)C1)=C(O)C=C(C)C7

Canonical SMILES

O=C1C2=C(O)C=C(C=C2C3=C4C=5C=C(C=C(O)C5C(=O)C6=C(O)C=C(O)C(C=7C(O)=CC(O)=C1C73)=C64)C)C

Other Names for this Substance

  • Dibenzo[a,o]perylene-7,16-dione, 1,3,4,6,8,15-hexahydroxy-10,13-dimethyl-
  • Helianthrone, 1,3,4,6,8,15-hexahydroxy-10,13-dimethyl-
  • 1,3,4,6,8,15-Hexahydroxy-10,13-dimethyldibenzo[a,o]perylene-7,16-dione
  • Protohypericin

Deleted or Replaced CAS Registry Numbers

54328-08-4

CAS INSIGHTSTM
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