ID: 92527
SMILES:C(=Cc1c(OC)c(O)c2c(c1)OC(C)(C)C1CC=C(C)CC21)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -13.338
InChIKey:VPUXUKMIXQFORV-UHFFFAOYSA-N
ID: 92528
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1=C2C(=O)C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -18.604
InChIKey:AUPXTHSHVYGTBU-UHFFFAOYSA-N
ID: 92529
SMILES:CC12C(c3c(O)c(C(=O)O)c(CCCCC)cc3O)(C=CC(C)(C)O1)CCC(C(O)(C)C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 462.583
CB1 binding score: -11.769
InChIKey:QYFBFFBOTUNRGL-UHFFFAOYSA-N
ID: 92530
SMILES:C(C1=CCC2C(C1)c1c(O)cc(CCCCC)cc1OC2(C)C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -16.502
InChIKey:ZSMQDXBPVJJPAD-UHFFFAOYSA-N
ID: 92531
SMILES:C1=C(C)C(Cc2c(O)cc(CCCCC)cc2O)C(C(C)=C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -15.775
InChIKey:JTCUALNLXGFDBG-UHFFFAOYSA-N
ID: 92532
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(CCC1C(C)(C)O1)(C)C(C=CC(C)(C)OO)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 432.601
CB1 binding score: -16.942
InChIKey:GTEMFYNCCFXHGF-UHFFFAOYSA-N
ID: 92533
SMILES:c1c(CO)cc2c(c1)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.436
CB1 binding score: -17.455
InChIKey:YDKZOUNVEIGJPO-UHFFFAOYSA-N
ID: 92534
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)C1CC=C(CCC=C(C)C)CC12)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.517
CB1 binding score: -13.502
InChIKey:CNHYPRAAKIHMOE-UHFFFAOYSA-N
ID: 92535
SMILES:C1=C(C)CCC2C(C)(C)Oc3c(c(O)c(O)cc3C=O)C2C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.37
CB1 binding score: -16.177
InChIKey:VCVOOPXQKWWBCL-UHFFFAOYSA-N
ID: 92536
SMILES:C(C=C(C)C)CC(C)=CCCC1(C)Oc2c(c(O)cc(CCCCC)c2)C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -19.944
InChIKey:PXPDKUHGJIMKBA-UHFFFAOYSA-N
ID: 92537
SMILES:C1C(C)=CC(c2ccc(CCCCC)cc2)C(C(C)=C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 282.471
CB1 binding score: -19.804
InChIKey:VGBLUPCGCQUYRW-UHFFFAOYSA-N
ID: 92538
SMILES:C(CCc1cc2c(c(O)c1)OC(C)(C)C1C2C=C(C(=O)OC)CC1)CC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.543
CB1 binding score: Not available
InChIKey:KZHBORCRCDEZEI-UHFFFAOYSA-N
ID: 92539
SMILES:C12C=C(C)CCC1C(C)(C)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 92540
SMILES:C(CCc1cc(O)c(CC=C(CCC(C(C)(C)O)O)C)c(O)c1)C(=O)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 366.454
CB1 binding score: -15.98
InChIKey:TZJKLOIEKKHHNP-UHFFFAOYSA-N
ID: 92541
SMILES:C1(C)C2=C(C(C)(C)Oc3c2c(OC)cc(CCCCC)c3)CCC1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -16.03
InChIKey:OFCPJJCOIPNREB-UHFFFAOYSA-N
ID: 92542
SMILES:c1c(O)c2c(cc1CCCCC)OC(C(C)(CO)O)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 280.364
CB1 binding score: -16.034
InChIKey:JJACNFMABFTJPW-UHFFFAOYSA-N
ID: 92543
SMILES:C(CCC)Cc1cc(O)c(CC=C(C)CCC=C(C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.666
InChIKey:QXACEHWTBCFNSA-UHFFFAOYSA-N
ID: 92544
SMILES:c1(CC=C(CCC=C(C)C)C)c(CCCCC)cc2c(c1O)C1C=C(C(=O)O1)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 408.582
CB1 binding score: -13.328
InChIKey:WEKSDLUYFLGYMQ-UHFFFAOYSA-N
ID: 92545
SMILES:c1(CCN)cc(C2C(C(C)=C)CCC(C)=C2)c(O)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 271.404
CB1 binding score: -17.581
InChIKey:YYKAXEGQUNPWQR-UHFFFAOYSA-N
ID: 92546
SMILES:C(CCCC)c1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 92547
SMILES:c1(O)c(C(C2(C)C=CC(C)CC3CC(C)(C)CC3C2=O)=O)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.597
CB1 binding score: -14.536
InChIKey:NUIAVAQZJQHUCE-UHFFFAOYSA-N