ID: 123544
SMILES:C1(c2c(O)cc(CCCCC)cc2OC)C(C(C)C)C2C(O)C(C(O)CC2(O)C)C(C)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 448.644
CB1 binding score: -14.984
InChIKey:JSGUWOYGNLOKJY-UHFFFAOYSA-N
ID: 123545
SMILES:CCCCCCc1cc(O)c(C2C(C(=C)C)CCC(C)=C2)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -18.609
InChIKey:HAKUWGCTBUVNJQ-UHFFFAOYSA-N
ID: 123546
SMILES:C1(C(CCC=C(C)C)C)C(c2c(O)cc(CCCO)cc2O)C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.549
CB1 binding score: -13.15
InChIKey:RBNNVCLMGFEWGW-UHFFFAOYSA-N
ID: 123547
SMILES:C(CO)OCCC(c1cc2c(cc1)C1C(C(C)(C)O2)CCC(C)=C1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -14.849
InChIKey:PQFOBFCTAOGWIU-UHFFFAOYSA-N
ID: 123548
SMILES:CC(=C)C1CCC(C)=CC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 123549
SMILES:C1C(CC=C(C)C)C(C)=CC(c2cc(O)c(CC=C(C)C)c(O)c2)C1C(=C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 380.572
CB1 binding score: -14.075
InChIKey:MXYYEAOXYMGMJA-UHFFFAOYSA-N
ID: 123550
SMILES:CC1(C)CCCC2=C1c1c(O)cc(C)cc1OC2(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -16.581
InChIKey:OVXMEFDREUUPEU-UHFFFAOYSA-N
ID: 123551
SMILES:C12C(CCCC1(C)C)C(C)(C)Oc1c2ccc(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.377
CB1 binding score: -16.597
InChIKey:HBHWCHNNLYFISU-UHFFFAOYSA-N
ID: 123552
SMILES:C1(c2c(O)cc(CCCCC)cc2O)C(C(C)=C)CCC(OC(C)(C)C)(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.592
CB1 binding score: -14.378
InChIKey:SFEJAIQZFXGUIQ-UHFFFAOYSA-N
ID: 123553
SMILES:CC1C(O)CC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -17.809
InChIKey:DMCFESRNYGRGSU-UHFFFAOYSA-N
ID: 123554
SMILES:O=CC1=CC2C(C(C)C)CCC(OC(C)=O)(C)C2CC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 456.623
CB1 binding score: -15.551
InChIKey:PDCYFWPSLWICNV-UHFFFAOYSA-N
ID: 123555
SMILES:O1c2cc(CCCCC)cc(O)c2C2CC1(C)CCC2C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.198
InChIKey:NUXUDGMVYZUFNQ-UHFFFAOYSA-N
ID: 123556
SMILES:c1(CCCCC)cc(O)c(C2C(C(C)=C)CC(O)C(C)=C2)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -18.385
InChIKey:YYLPAYRRVSQJRR-UHFFFAOYSA-N
ID: 123557
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)C1C2CC(=C)CC1)CCCCCCCCO
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.63
CB1 binding score: -15.863
InChIKey:XMCVNCVQEZBHRW-UHFFFAOYSA-N
ID: 123558
SMILES:CC(CC(O)C=C(C)C)=CCc1c(O)cc(CCCCC)cc1OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -17.637
InChIKey:XMWIJDBLYLDQAJ-UHFFFAOYSA-N
ID: 123559
SMILES:C(C1CCC(C)=CC1c1c(O)cc(CCC)cc1O)(C)(C)O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -19.168
InChIKey:BMEOABJGGIYLGA-UHFFFAOYSA-N
ID: 123560
SMILES:CC12C3CCC(=C)C1(Oc1c(C(C(CC)C)=O)c(O)cc(CC=C(C)C)c12)C=CC(C)(C)O3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 450.619
CB1 binding score: -16.015
InChIKey:OVIJIXLTEOETCH-UHFFFAOYSA-N
ID: 123561
SMILES:C1(C)(O)CCC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -20.807
InChIKey:KSGRDIFQZVURIF-UHFFFAOYSA-N
ID: 123562
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)C1C2C=C(C)CC1)P(=O)(O)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 366.394
CB1 binding score: -14.366
InChIKey:RXPVDIHMRWAYLO-UHFFFAOYSA-N
ID: 123563
SMILES:OC12CCC(C)CC1c1c(O)cc(CCCCC)cc1OOC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -13.441
InChIKey:WLQKTEKEYWUFBJ-UHFFFAOYSA-N
ID: 123564
SMILES:C(CCc1cc(O)c(C2C=C(C)CCC2C(C)=C)c(O)c1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -19.739
InChIKey:WBRXESQKGXYDOL-UHFFFAOYSA-N