Chem
J-GLOBAL ID:200907030519102427
Nikkaji number:J509.952H
(2S,3aα,7aα)-Octahydro-5-(phosphonomethyl)-1H-indole-2α-carboxylic acid
(2S,3aR,7aR)-5-(ホスホノメチル)-オクタヒドロ-1H-インドール-2-カルボン酸
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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:
C10 H18 NO5 P
Molecular formula furigana:
C10-H18-N-O5-P
Molecular weight:
263.230
InChI:
InChI=1S/C10H18NO5P/c12-10(13)9-4-7-3-6(5-17(14,15)16)1-2-8(7)11-9/h6-9,11H,1-5H2,(H,12,13)(H2,14,15,16)/t6?,7-,8-,9+/m1/s1
InChI key:
ZGDIQOPHIIVQPI-GXIMGVEYSA-N
SMILES:
OC(=O)[C@@H]1C[C@H]2CC(CP(=O)(O)O)CC[C@H]2N1
Systematic name (3):
(2S,3aα,7aα)-オクタヒドロ-5-(ホスホノメチル)-1H-インドール-2α-カルボン酸
(2S,3aR,7aR)-5-(ホスホノメチル)-オクタヒドロ-1H-インドール-2-カルボン酸
(2S,3aR,7aR)-5-(phosphonomethyl)-octahydro-1H-indole-2-carboxylic acid
Other name (1):
(2S,3aα,7aα)-Octahydro-5-(phosphonomethyl)-1H-indole-2α-carboxylic acid
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