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diheptadecyl (2R)-2-{[(2R)-2-{[(2S)-2-{[(2S,3R,4R,5S,6R)-3-(acetylamino)-2-(benzyloxy)-5-hydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-4-yl]oxy}propanoyl]amino}propanoyl]amino}pentanedioate (non-preferred name)

Catalog ID
STL564391
SMILES CCCCCCCCCCCCCCCCCOC(=O)CC[C@H](C(=O)OCCCCCCCCCCCCCCCCC)NC(=O)[C@H](NC(=O)[C@@H](O[C@H]1[C@H](O)[C@@H](CO)O[C@@H]([C@@H]1NC(=O)C)OCc1ccccc1)C)C

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C60H105N3O12 MW 1060.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C60H105N3O12/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-37-43-71-53(66)42-41-51(59(70)72-44-38-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2)63-57(68)47(3)61-58(69)48(4)74-56-54(62-49(5)65)60(75-52(45-64)55(56)67)73-46-50-39-35-34-36-40-50/h34-36,39-
InChIKey
LLOQKXJUMRHOKQ-RKIVKHRJSA-N
Synonyms
1491139-15-1
(R)diheptadecyl2((R)2((S)2(((2S3R4R5S6R)3acetamido2(benzyloxy)5hydroxy6(hydroxymethyl)tetrahydro2Hpyran4yl)oxy)propanamido)propanamido)pentanedioate
1491139151
16395393
CCCCCCCCCCCCCCCCCOC(=O)CC(C@H)(C(=O)OCCCCCCCCCCCCCCCCC)NC(=O)(C@H)(NC(=O)(C@@H)(O(C@H)1(C@H)(O)(C@@H)(CO)O(C@@H)((C@@H)1NC(=O)C)OCc1ccccc1)C)C
DIHEPTADECYL(2R)2(((2R)2(((2S)2(((2S3R4R5S6R)3(ACETYLAMINO)2(BENZYLOXY)5HYDROXY6(HYDROXYMETHYL)TETRAHYDRO2HPYRAN4YL)OXY)PROPANOYL)AMINO)PROPANOYL)AMINO)PENTANEDIOATE(NONPREFER
diheptadecyl(2R)2(((2R)2(((2S)2(((2S3R4R5S6R)3(acetylamino)2(benzyloxy)5hydroxy6(hydroxymethyl)tetrahydro2Hpyran4yl)oxy)propanoyl)amino)propanoyl)amino)pentanedioate(nonpreferredname)
diheptadecyl(2R)2(((2R)2(((2S)2((2R3S4R5R6S)5acetamido3hydroxy2(hydroxymethyl)6phenylmethoxyoxan4yl)oxypropanoyl)amino)propanoyl)amino)pentanedioate
InChI=1SC60H105N3O12c16810121416182022242628303237437153(66)424151(59(70)724438333129272523211917151311972)6357(68)47(3)6158(69)48(4)745654(6249(5)65)60(7552(4564)55(56)67)734650393534364050h34363940474851525456606467H63337384146H215H3(H6169)(H6265)(
MFCD32651457

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Available files

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