Chem
J-GLOBAL ID：200907090629822010   Nikkaji number：J2.765.236K

5,10,15,20-Tetrakis[3,4,5-tris(dodecyloxy)phenyl]-21H,23H-porphyrin

5,10,15,20-テトラキス[3,4,5-トリス(ドデシルオキシ)フェニル]-21H,23H-ポルフィリン
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： C188H318N4O12
Molecular formula furigana： C188-H318-N4-O12
Molecular weight： 2826.628
InChI： InChI=1S/C188H318N4O12/c1-13-25-37-49-61-73-85-97-109-121-141-193-173-153-161(154-174(194-142-122-110-98-86-74-62-50-38-26-14-2)185(173)201-149-129-117-105-93-81-69-57-45-33-21-9)181-165-133-135-167(189-165)182(162-155-175(195-143-123-111-99-87-75-63-51-39-27-15-3)186(202-150-130-118-106-94-82-70-58-46-34-22-10)176(156-162)196-144-124-112-100-88-76-64-52-40-28-16-4)169-137-139-171(191-169)184(164-159-179(199-147-127-115-103-91-79-67-55-43-31-19-7)188(204-152-132-120-108-96-84-72-60-48-36-24-12)180(160-164)200-148-128-116-104-92-80-68-56-44-32-20-8)172-140-138-170(192-172)183(168-136-134-166(181)190-168)163-157-177(197-145-125-113-101-89-77-65-53-41-29-17-5)187(203-151-131-119-107-95-83-71-59-47-35-23-11)178(158-163)198-146-126-114-102-90-78-66-54-42-30-18-6/h133-140,153-160,189,192H,13-132,141-152H2,1-12H3/b181-165-,181-166-,182-167-,182-169-,183-168-,183-170-,184-171-,184-172-
InChI key： JXQZXHHVRJPHOW-IVXYQSTHSA-N
SMILES： CCCCCCCCCCCCOc1cc(cc(OCCCCCCCCCCCC)c1OCCCCCCCCCCCC)/C/1=c/2\cc/c(=C(/C3=N/C(=C(\c4ccc(/C(=C\5/C=CC1=N5)/c1cc(OCCCCCCCCCCCC)c(OCCCCCCCCCCCC)c(OCCCCCCCCCCCC)c1)[nH]4)/c1cc(OCCCCCCCCCCCC)c(OCCCCCCCCCCCC)c(OCCCCCCCCCCCC)c1)/C=C3)\c1cc(OCCCCCCCCCCCC)c(OCCCCCCCCCCCC)c(OCCCCCCCCCCCC)c1)/[nH]2
Systematic name  (3)：
  • 5,10,15,20-テトラキス[3,4,5-トリス(ドデシルオキシ)フェニル]-21H,23H-ポルフィリン
  • 2,7,12,17-テトラキス[3,4,5-トリス(ドデシルオキシ)フェニル]-21,22,23,24-テトラアザペンタシクロ[16.2.1.13,6.18,11.113,16]テトラコサ-1,3,5,7,9,11(23),12,14,16,18(21),19-ウンデカエン
  • 2,7,12,17-tetrakis[3,4,5-tris(dodecyloxy)phenyl]-21,22,23,24-tetraazapentacyclo[16.2.1.13,6.18,11.113,16]tetracosa-1,3,5,7,9,11(23),12,14,16,18(21),19-undecaene
Other name (1)：
  • 5,10,15,20-Tetrakis[3,4,5-tris(dodecyloxy)phenyl]-21H,23H-porphyrin
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