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Substance Name: 6,6'-Di-O-mycoloyl-alpha-mannopyranosyl-alpha-mannopyranoside
RN: 59578-11-9
InChIKey: MOGDADYOLSGDFB-FDJAZNRZSA-N

Note

  • Cord factor analog.

Molecular Weight

  • 2750.7
 
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Names and Synonyms

Name of Substance

  • 6,6'-Di-O-mycoloyl-alpha-mannopyranosyl-alpha-mannopyranoside

Synonyms

  • 6,6'-Di-O-mycoloyl-alpha-D-mannopyranosyl-alpha-D-mannopyranoside
  • di-Mmm

Systematic Name

  • alpha-D-Glucopyranoside, 6-O-(2-(18-(2-(14-(2-eicosylcyclopropyl)tetradecyl)cyclopropyl)-1-hydroxyoctadecyl)-1-oxohexacosyl)-alpha-D-glucopyranosyl, stereoisomer

Registry Numbers

CAS Registry Number

  • 59578-11-9

System Generated Number

  • 0059578119

Structure Descriptors

InChI

1S/C180H346O15/c1-5-9-13-17-21-25-29-33-37-41-45-47-49-51-55-63-71-87-99-111-123-135-147-165(167(181)149-137-125-113-101-89-73-65-57-61-69-81-93-105-117-129-141-159-153-163(159)145-133-121-109-97-85-77-75-83-95-107-119-131-143-161-151-157(161)139-127-115-103-91-79-67-59-53-43-39-35-31-27-23-19-15-11-7-3)177(189)191-155-169-171(183)173(185)175(187)179(193-169)195-180-176(188)174(186)172(184)170(194-180)156-192-178(190)166(148-136-124-112-100-88-72-64-56-52-50-48-46-42-38-34-30-26-22-18-14-10-6-2)168(182)150-138-126-114-102-90-74-66-58-62-70-82-94-106-118-130-142-160-154-164(160)146-134-122-110-98-86-78-76-84-96-108-120-132-144-162-152-158(162)140-128-116-104-92-80-68-60-54-44-40-36-32-28-24-20-16-12-8-4/h157-176,179-188H,5-156H2,1-4H3/t157?,158?,159?,160?,161?,162?,163?,164?,165?,166?,167?,168?,169-,170-,171-,172-,173+,174+,175-,176-,179-,180-/m1/s1

InChIKey

MOGDADYOLSGDFB-FDJAZNRZSA-N

Smiles

O([C@@H]1[C@H](O)[C@@H](O)[C@H](O)[C@H](O1)COC([C@@H]([C@@H](CCCCCCCCCCCCCCCCC[C@@H]1[C@@H](C1)CCCCCCCCCCCCCC[C@@H]1[C@@H](C1)CCCCCCCCCCCCCCCCCCCC)O)CCCCCCCCCCCCCCCCCCCCCCCC)=O)[C@@H]1[C@H](O)[C@@H](O)[C@H](O)[C@H](O1)COC([C@@H](CCCCCCCCCCCCCCCCCCCCCCCC)[C@@H](CCCCCCCCCCCCCCCCC[C@@H]1[C@@H](C1)CCCCCCCCCCCCCC[C@@H]1[C@@H](C1)CCCCCCCCCCCCCCCCCCCC)O)=O