Chem
J-GLOBAL ID:200907030449857654
Nikkaji number:J1.462.783I
PM-toxin B
PMトキシンB
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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:
C33 H62 O8
Molecular formula furigana:
C33-H62-O8
Molecular weight:
586.851
InChI:
InChI=1S/C33H62O8/c1-3-4-8-15-28(36)23-29(37)18-11-6-12-19-32(40)25-33(41)21-14-7-13-20-31(39)24-30(38)17-10-5-9-16-27(35)22-26(2)34/h26-28,31-32,34-36,39-40H,3-25H2,1-2H3/t26-,27+,28+,31+,32+/m0/s1
InChI key:
ISDLLJGHFWSQQK-ZHTCHCOESA-N
SMILES:
CCCCC[C@@H](O)CC(=O)CCCCC[C@@H](O)CC(=O)CCCCC[C@@H](O)CC(=O)CCCCC[C@@H](O)C[C@H](C)O
Systematic name (3):
(6R,14R,22R,30R,32S)-6,14,22,30,32-ペンタヒドロキシトリトリアコンタン-8,16,24-トリオン
(2S,4R,12R,20R,28R)-2,4,12,20,28-ペンタヒドロキシトリトリアコンタン-10,18,26-トリオン
(6R,14R,22R,30R,32S)-6,14,22,30,32-pentahydroxytritriacontane-8,16,24-trione
Other name (6):
(6R,14R,22R,30R,32S)-6,14,22,30,32-Pentahydroxytritriacontane-8,16,24-trione
PMトキシンB
PM toxin B
(2S,4R,12R,20R,28R)-2,4,12,20,28-Pentahydroxytritriacontane-10,18,26-trione
PM-トキシンB
PM-toxin B
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