Chem
J-GLOBAL ID:200907045290324274   Nikkaji number:J2.300.300G

Globostellatic acid G

グロボステラト酸G
Substance type:
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula: C31H46O6
Molecular formula furigana: C31-H46-O6
Molecular weight: 514.703
InChI: InChI=1S/C31H46O6/c1-19(12-13-25(37-8)28(3,4)36)10-9-11-20(2)26-21(32)18-23-29(5)17-15-24(33)31(7,27(34)35)22(29)14-16-30(23,26)6/h9-13,22-25,33,36H,14-18H2,1-8H3,(H,34,35)/b11-9+,13-12+,19-10+,26-20+/t22-,23+,24-,25?,29+,30+,31-/m1/s1
InChI key: SZHMATBACCQYNZ-LMRICTRBSA-N
SMILES: COC(/C=C/C(=C/C=C/C(=C/1\C(=O)C[C@@H]2[C@]1(C)CC[C@@H]1[C@]2(C)CC[C@@H](O)[C@]1(C)C(=O)O)/C)/C)C(C)(C)O
Systematic name  (3):
  • (8S,9S,13Z,15E,17E,22E)-3α,25-ジヒドロキシ-24-メトキシ-12-オキソ-5α-マラバリカ-13,15,17(20),22-テトラエン-29-酸
  • (3Z,3aS,5aR,6R,7R,9aR,9bS)-7-ヒドロキシ-3-[(3E,5E,7E)-10-ヒドロキシ-9-メトキシ-6,10-ジメチルウンデカ-3,5,7-トリエン-2-イリデン]-3a,6,9a-トリメチル-2-オキソ-ドデカヒドロ-1H-シクロペンタ[a]ナフタレン-6-カルボン酸
  • (3Z,3aS,5aR,6R,7R,9aR,9bS)-7-hydroxy-3-[(3E,5E,7E)-10-hydroxy-9-methoxy-6,10-dimethylundeca-3,5,7-trien-2-ylidene]-3a,6,9a-trimethyl-2-oxo-dodecahydro-1H-cyclopenta[a]naphthalene-6-carboxylic acid
Other name (3):
  • (8S,9S,13Z,15E,17E,22E)-3α,25-Dihydroxy-24-methoxy-12-oxo-5α-malabarica-13,15,17(20),22-tetraene-29-oic acid
  • Globostellatic acid G
  • グロボステラト酸G
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