ID: 6700
SMILES:O=C(C)OC1(C)CCC(C(C)=C)C(c2cc(CC(C)C)ccc2)C=C1COCO
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.559
CB1 binding score: -15.855
InChIKey:PETMDNXNLUQDHG-UHFFFAOYSA-N
ID: 6701
SMILES:O1c2cc(CCCCC)cc(OC)c2C2C(C(C)(O)C)CCC(C)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -12.209
InChIKey:NDMDWKBXAUKCRV-UHFFFAOYSA-N
ID: 6702
SMILES:c12cc(C)cc(O)c1C1C(C(C)(C)O2)CCC1(C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 262.349
CB1 binding score: -18.334
InChIKey:IFGUCKOSTCKUDI-UHFFFAOYSA-N
ID: 6703
SMILES:C(O)C1=CC2c3c(cc(CCCCC)c(C(=O)O)c3O)OC1CC2C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -15.092
InChIKey:JCBRARBGKZQJHX-UHFFFAOYSA-N
ID: 6704
SMILES:OC(CCc1cc(O)c(C2C=C(C)C(=O)CC2C(C)CCC=C(C)C)cc1)=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.516
CB1 binding score: -14.412
InChIKey:KXFUOKXJOBGOEU-UHFFFAOYSA-N
ID: 6705
SMILES:COc1cc(C)cc(O)c1C1C(C(C)=C)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -17.99
InChIKey:JIAMDLHQCKSETM-UHFFFAOYSA-N
ID: 6706
SMILES:C(CCCCc1cc2c(c(O)c1C(=O)CC(C)C)CC(C(=C)C)C1C(=O)C(C)(C)C2=C1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 436.636
CB1 binding score: -14.384
InChIKey:IGJULLKXSDZAON-UHFFFAOYSA-N
ID: 6707
SMILES:C1(C)(C)Oc2cc(CCCCC)c(C(=O)O)cc2C2C1CCC(C)(O)C2O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.493
CB1 binding score: -14.605
InChIKey:BRAKWPFOPSJILE-UHFFFAOYSA-N
ID: 6708
SMILES:c1c(CCCCC)cc(O)c2c1OC1(C2(O)C)C(=O)C(C)(C)OC1C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.439
CB1 binding score: -14.645
InChIKey:QASXEJGWCOJCRZ-UHFFFAOYSA-N
ID: 6709
SMILES:c1c2c(c(C=O)cc1)-c1c(O)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 324.42
CB1 binding score: -15.929
InChIKey:URYODILJIDQGRE-UHFFFAOYSA-N
ID: 6710
SMILES:C(C=C)c1cc2c(c(O)c1CCCCC)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.534
CB1 binding score: -15.135
InChIKey:RYFYTQBMWOSMNP-UHFFFAOYSA-N
ID: 6711
SMILES:c1(O)cc2c(cc1CCCCC)OC1CC(C)CCC1C2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -16.753
InChIKey:XJTDQSVLYZBFPC-UHFFFAOYSA-N
ID: 6712
SMILES:C12C(=O)C3C(C(C)C1c1c(cc(CCCCC)cc1O)O2)CC(C)C3=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.462
CB1 binding score: -16.755
InChIKey:OYUBKECNJCQEEW-UHFFFAOYSA-N
ID: 6713
SMILES:OC(C)Cc1cc2c(c(O)c1)C1C(C(C)(C)O2)CC=C(C(=O)O)CCCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.515
CB1 binding score: -14.286
InChIKey:URVBBMZFSCCHAH-UHFFFAOYSA-N
ID: 6714
SMILES:C(CCC)Cc1cc2c(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: 6715
SMILES:OC12C=C(C)C(=O)CC1C(C)(C)Oc1c2c(OC)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -16.943
InChIKey:VUJHOAAGMDBVAN-UHFFFAOYSA-N
ID: 6716
SMILES:C(C(CCc1ccc(O)cc1C1=C2OC(C)(C)C3CC(C)(C(=O)O1)C32)(O)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.488
CB1 binding score: -14.866
InChIKey:NMGOYMOZOYMJGM-UHFFFAOYSA-N
ID: 6717
SMILES:C(CCCC1(C)Oc2cc(C)c(OC)cc2C2C1CC(C)=CC2)CC(=O)O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -16.065
InChIKey:FVLKHLVMMRPOMI-UHFFFAOYSA-N
ID: 6718
SMILES:CC1(C)Oc2c(c(O)c(CC=C(C)C)c(O)c2)C2C1CCC2(O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -15.929
InChIKey:MIOPEUJEFLZAMI-UHFFFAOYSA-N
ID: 6719
SMILES:CC1=CC(c2c(O)cc(CCCCC)cc2O)C(C(C)=C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 6720
SMILES:CC1=CC(c2ccc(CCCC)cc2)C(C(C)C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 270.46
CB1 binding score: -18.171
InChIKey:QBUIJIADVGCWQN-UHFFFAOYSA-N