Chem
J-GLOBAL ID：200907097451363135   Nikkaji number：J1.457.020I

Labda-8(20),13-dien-15-ol 15-diphosphoric acid

ラブダ-8(20),13-ジエン-15-オール15-二りん酸
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： C20H36O7P2
Molecular formula furigana： C20-H36-O7-P2
Molecular weight： 450.449
InChI： InChI=1S/C20H36O7P2/c1-15(11-14-26-29(24,25)27-28(21,22)23)7-9-17-16(2)8-10-18-19(3,4)12-6-13-20(17,18)5/h11,17-18H,2,6-10,12-14H2,1,3-5H3,(H,24,25)(H2,21,22,23)/t17-,18-,20+/m0/s1
InChI key： JCAIWDXKLCEQEO-CMKODMSKSA-N
SMILES： CC(=CCOP(=O)(O)OP(=O)(O)O)CC[C@H]1C(=C)CC[C@H]2C(C)(C)CCC[C@]12C
Systematic name  (5)：
  • 二りん酸P1-[ラブダ-8(20),13-ジエン-15-イル]
  • ラブダ-8(20),13-ジエン-15-オール15-二りん酸
  • 二りん酸α-[3-メチル-5-[(1S,4aα)-2-メチレン-5,5,8aβ-トリメチルデカヒドロナフタレン-1β-イル]-2-ペンテニル]
  • {[({5-[(1S,4aS,8aS)-5,5,8a-トリメチル-2-メチリデン-デカヒドロナフタレン-1-イル]-3-メチルペンタ-2-エン-1-イル}オキシ)(ヒドロキシ)ホスホリル]オキシ}ホスホン酸
  • {[({5-[(1S,4aS,8aS)-5,5,8a-trimethyl-2-methylidene-decahydronaphthalen-1-yl]-3-methylpent-2-en-1-yl}oxy)(hydroxy)phosphoryl]oxy}phosphonic acid
Other name (3)：
  • Labda-8(20),13-dien-15-ol 15-diphosphoric acid
  • Diphosphoric acid P1-[labda-8(20),13-dien-15-yl] ester
  • Diphosphoric acid α-[3-methyl-5-[(1S,4aα)-2-methylene-5,5,8aβ-trimethyldecahydronaphthalene-1β-yl]-2-pentenyl] ester
KEGG COMPOUND： C11901
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