ID: 90469
SMILES:CC(C)C1(O)CC(OC(=O)C)C(C)=CC1c1c(O)cc(CCCCC)cc1OC(CCCCCCCCC)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 544.773
CB1 binding score: -15.733
InChIKey:WTWXYCGCWYIGOK-UHFFFAOYSA-N
ID: 90470
SMILES:C1CCC(C)C2(C)CC=C(C)CC12Oc1c(O)ccc(CCC(O)C(C=CC(=CCc2c(O)c(C)cc(OC)c2)C)=O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 588.785
CB1 binding score: -18.369
InChIKey:BDMLPNDMXVOYPB-UHFFFAOYSA-N
ID: 90471
SMILES:Oc1cc2c(c3c1c(OC)ccc3)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 324.42
CB1 binding score: -15.369
InChIKey:WEUMLUYQZYKDIG-UHFFFAOYSA-N
ID: 90472
SMILES:C1(C)C(O)C2C(C(C)(C)Oc3cc(O)cc(C)c32)C2(O)CC(=O)C(C)=CC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.461
CB1 binding score: -17.712
InChIKey:WWXGOTAPMBDDLD-UHFFFAOYSA-N
ID: 90473
SMILES:C1(=O)C=C(C)C2C1c1c(cc(CCC)cc1O)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.371
CB1 binding score: -15.416
InChIKey:VFTXHJBLTYFIBE-UHFFFAOYSA-N
ID: 90474
SMILES:C1C2(C)C(C)CCC(O)C2C(=O)C2=C1c1c(O)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.57
CB1 binding score: -14.349
InChIKey:LCKCBVZTFMATBJ-UHFFFAOYSA-N
ID: 90475
SMILES:c1c2c(c(C(CC)=O)c(O)c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.398
CB1 binding score: -17.611
InChIKey:SQPRCSOYEAPBFA-UHFFFAOYSA-N
ID: 90476
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1)CCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -18.687
InChIKey:RGXKCMQANRHRCO-UHFFFAOYSA-N
ID: 90477
SMILES:C1(c2c(O)cc(CCCCC)cc2O)C(C(C)=C)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 90478
SMILES:O(C1C2(C)Oc3cc(CCCCC)cc(OC)c3C2C2C(C)(C(C3COC(=O)C3)CC2)C1)C(=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 484.633
CB1 binding score: -13.944
InChIKey:WTBSGTZRKJOFLD-UHFFFAOYSA-N
ID: 90479
SMILES:C(Cc1cc2c(c(O)c1)-c1c(ccc(C)c1)C(C)(C)O2)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -19.554
InChIKey:VBGLYOIFKLUMQG-UHFFFAOYSA-N
ID: 90480
SMILES:C(Cc1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)(O)C(O)C1)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.456
CB1 binding score: -14.13
InChIKey:OPMBUVVEZNKEAL-UHFFFAOYSA-N
ID: 90481
SMILES:C1(Br)CC(C(C)=C)C(c2cc(O)cc(CCCCC)c2)CC1(C)O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 395.381
CB1 binding score: -15.36
InChIKey:LJTWMYLVPKHWLQ-UHFFFAOYSA-N
ID: 90482
SMILES:c1(CCCC)cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -20.843
InChIKey:QHCQSGYWGBDSIY-UHFFFAOYSA-N
ID: 90483
SMILES:CCCCCCc1cc(OC)c2c(c1)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -17.593
InChIKey:ZVQFNKGBTCDWCZ-UHFFFAOYSA-N
ID: 90484
SMILES:C(CC)Cc1c(O)cc(O)c(CC=C(C)CCC=C(C)C)c1
Pathway: Polyketides
Superclass: Meroterpenoids;Aromatic polyketides
Class: Cannabinoids;Catechols with side chains
MW: 302.458
CB1 binding score: -16.664
InChIKey:ICEHRRCMNXEDLK-UHFFFAOYSA-N
ID: 90485
SMILES:c1(O)cc(CCCC)cc2c1OC(C)(C)C1(O)C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -13.394
InChIKey:CGGZXPBDLSQIHP-UHFFFAOYSA-N
ID: 90486
SMILES:C1CC(C)(C2C(C(C)=CCC=C(C)C)Oc3cc(CCCCC)cc(O)c32)C(=O)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.597
CB1 binding score: -16.319
InChIKey:NVSPOSYMYZCIJE-UHFFFAOYSA-N
ID: 90487
SMILES:C(CCCC)c1cc(O)c2c(c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 90488
SMILES:c1c(-c2c(O)cc(CCCCC)cc2)cc(O)c(CC2C(C)=CCCC2(C)C)c1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 408.582
CB1 binding score: -14.614
InChIKey:XAZHKCFJWZZEOU-UHFFFAOYSA-N
ID: 90489
SMILES:c1(CCCCC)cc(O)c(C2C(C(C)(C)O)CC=C(C)C2)c(O)c1C=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -16.292
InChIKey:ZRQSYOFLPAYTIG-UHFFFAOYSA-N