ID: 59452
SMILES:C1CC(C(C)C)C(c2c(O)cc(CCCC)cc2O)C=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -18.479
InChIKey:QHFVULIOBFWRAD-UHFFFAOYSA-N
ID: 59453
SMILES:C12(C)C(C)(CC(CC1)C(C)(C)C#N)Oc1c(c(O)cc(CCCCC)c1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 369.549
CB1 binding score: -14.309
InChIKey:WVGIAACLOXJKKO-UHFFFAOYSA-N
ID: 59454
SMILES:C(c1cc(C(O)=O)c(O)c2c1OC(C)(C)C1CCC(C)=CC21)CC=C(C)CCC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 438.608
CB1 binding score: -16.491
InChIKey:NXRJBJFQWMAWLI-UHFFFAOYSA-N
ID: 59455
SMILES:CC1(C)OC2CC3(c4c(cc(CCCCC)cc4OC)OC3Oc3c(O)c(OC)ccc3)CCC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 482.617
CB1 binding score: -16.918
InChIKey:SDBWZRJOMIDMOB-UHFFFAOYSA-N
ID: 59456
SMILES:C(CCCC)c1cc2c(c(O)c1)C1C=C(C(=O)O)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -20.052
InChIKey:YOVRGSHRZRJTLZ-UHFFFAOYSA-N
ID: 59457
SMILES:c1(CCCCC)cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 59458
SMILES:C(CCC)Cc1cc2c(c(O)c1)C=CC(C)(CCC=C(C)C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.933
InChIKey:UVOLYTDXHDXWJU-UHFFFAOYSA-N
ID: 59459
SMILES:C12C(C)(C)C=CC(=O)C13Oc1c(c(O)cc(CCCCC)c1)C(O)C3(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.516
CB1 binding score: -12.368
InChIKey:YMIYUKIOURMCFF-UHFFFAOYSA-N
ID: 59460
SMILES:C12C(C)=CCC1C(C)(C)Oc1cc(C)ccc12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 228.335
CB1 binding score: -16.188
InChIKey:XCCYCELLJLUHIX-UHFFFAOYSA-N
ID: 59461
SMILES:c1(CCCC)c2c3c(c(O)c1O)CC1C(C)(O3)CCC(C(C)=C)OC1O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.45
CB1 binding score: -12.258
InChIKey:ZTLDWJMFHIAWFE-UHFFFAOYSA-N
ID: 59462
SMILES:c1(CCCCC)cc2c(c(O)c1)C1CC(C)=CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 59463
SMILES:C(CC1C(C)(C)Oc2cc(CCCCC)cc(O)c21)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -15.683
InChIKey:VJKOBDCVNHDERP-UHFFFAOYSA-N
ID: 59464
SMILES:O1c2c(cc(CCCCC)cc2OC)C=C(C)CCC(O)C1(O)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.456
CB1 binding score: -15.22
InChIKey:XNMXOAIRZCWBDD-UHFFFAOYSA-N
ID: 59465
SMILES:C(CCCc1cc(O)c2c(c1O)C=CC(CCC=C(C)C)(C)O2)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -15.288
InChIKey:FKOZPAYXTBOMJM-UHFFFAOYSA-N
ID: 59466
SMILES:C(=C(C)C)CCC(C)=CCc1c(O)cc(CCCCC)c(C(OC)=O)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 374.521
CB1 binding score: -19.567
InChIKey:RSOBBJCWWQRAAM-UHFFFAOYSA-N
ID: 59467
SMILES:c1(O)cc(CCCCC)cc2c1-c1c(O)c(CC(O)C(=C)C)c(O)cc1OC2(C)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 480.645
CB1 binding score: -13.749
InChIKey:JUZNKZTZWSKZDS-UHFFFAOYSA-N
ID: 59468
SMILES:C(CCCC)Cc1cc(O)c(C2OC(=O)C(C)=C2)c(C)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -15.651
InChIKey:KGUSXEJTVRZEOE-UHFFFAOYSA-N
ID: 59469
SMILES:C1C(=C)CCCC(C)(C)Oc2cc(CCCCC)cc(O)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -15.402
InChIKey:OQPAKEIHZOABDX-UHFFFAOYSA-N
ID: 59470
SMILES:CC(C)=CC(=O)c1c(C2C(C(O)(C)C)CCC3(C)Oc4c(c(OC)cc(CCCCC)c4)C3C2)ccc(C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 532.765
CB1 binding score: -15.929
InChIKey:ZCZAHULKIQWKLI-UHFFFAOYSA-N
ID: 59471
SMILES:C(C(C)=CCc1c(O)c2c(c(C(C(CC)C)=O)c1O)OC(C)(C)C1CC=C(C)CC21)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.569
CB1 binding score: -12.157
InChIKey:HTRBSZVJZVOVOI-UHFFFAOYSA-N
ID: 59472
SMILES:C(C)(C1C(c2c(O)cc(CCC(O)CC)cc2O)C(C(O)(C)CCC)OC1)=CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 460.655
CB1 binding score: -14.906
InChIKey:LQLYRROOEVIOPB-UHFFFAOYSA-N