ID: 44794
SMILES:O1c2cc(CCCCC)cc(O)c2C2C1CC1C(C)(CCC3C(C1)C3(C)C)C2=C(C)C(=O)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 452.635
CB1 binding score: -14.165
InChIKey:UKBKFPWDEPUHTD-UHFFFAOYSA-N
ID: 44795
SMILES:CC(CCC=C(C)C)=CCCC1=CCC(c2c(O)cc(CCCC)cc2O)OC1=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.57
CB1 binding score: -18.424
InChIKey:FYUANFWVLNZAIZ-UHFFFAOYSA-N
ID: 44796
SMILES:CC(=CCc1c(O)c(C(O)=O)c(CCCCC)cc1O)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 292.375
CB1 binding score: -19.394
InChIKey:IQDBYPKRWVDTCI-UHFFFAOYSA-N
ID: 44797
SMILES:C(C)CCCc1cc2c(c(O)c1)C1=C(C(CCC=C(C)C)C)C(C=C(C)C)CC(C)C1CC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 448.735
CB1 binding score: -15.428
InChIKey:WIJSULVLVKPVHO-UHFFFAOYSA-N
ID: 44798
SMILES:c1c(O)c(C(CCCC)C)cc(O)c1CC=C(C)CCC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -14.917
InChIKey:OSLPWOXDFBTZFY-UHFFFAOYSA-N
ID: 44799
SMILES:C(C=C(CCC=C(C)C)C)c1cc(O)cc(CCC)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.432
CB1 binding score: -17.917
InChIKey:BYYZHJIATPYDTN-UHFFFAOYSA-N
ID: 44800
SMILES:C1(=O)C(C)(C=CC=C(C)C)Oc2c(c(O)cc(CCCCC)c2)C(CC=C(C)C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.598
CB1 binding score: -13.559
InChIKey:HBSFCRGDFSYVLQ-UHFFFAOYSA-N
ID: 44801
SMILES:C1=C(C)CCC2C(C)(C)Oc3cc(C(C)C)ccc3C12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 270.416
CB1 binding score: -18.616
InChIKey:ZPASLEJAPOOBOK-UHFFFAOYSA-N
ID: 44802
SMILES:Oc1c2c(cc(C(C)(O)CCCC(C)(C)O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.548
CB1 binding score: -16.373
InChIKey:CQSBAIHVQPQFOR-UHFFFAOYSA-N
ID: 44803
SMILES:c1(CC(C)C)cc(O)c2c(c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -18.498
InChIKey:RXRWRQLAHZMMRU-UHFFFAOYSA-N
ID: 44804
SMILES:Oc1cc(CCCCC)c(O)cc1C1(C)CC=C(CCC(O)C(C)=C)C(=O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.504
CB1 binding score: -12.172
InChIKey:AAIMRPXXXYKYDQ-UHFFFAOYSA-N
ID: 44805
SMILES:O=C(C)OC1C(O)CC2OC1c1c(cc(CCCCC)cc1O)OC(=O)C2=C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.432
CB1 binding score: -14.467
InChIKey:QWLDBEYCABGUCI-UHFFFAOYSA-N
ID: 44806
SMILES:c12c(ccc(OC)c1O)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -17.334
InChIKey:GFQYLAVBKLTRDE-UHFFFAOYSA-N
ID: 44807
SMILES:CC(=CCc1c(O)cc(CCc2ccccc2)cc1O)CCC=C(CCC=C(C)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 418.621
CB1 binding score: -19.13
InChIKey:IWSASXREQYAISF-UHFFFAOYSA-N
ID: 44808
SMILES:C1(C(C)=C)C(c2c(O)cc(CCCCC)cc2O)C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 44809
SMILES:CC1(C)C(c2c(OC(CCCCCCCC)=O)cc(C)cc2)=C(C)CCC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.577
CB1 binding score: -13.623
InChIKey:IOCKJYQZPBPQMS-UHFFFAOYSA-N
ID: 44810
SMILES:C(c1c(=O)c(O)c(O)c2c(c1)C1CC(C)=CCC1C(C)(C)O2)(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -15.183
InChIKey:PQNWRVHPMTVGPW-UHFFFAOYSA-N
ID: 44811
SMILES:C1CC(C(=C)C)C(c2c(O)cc(O)cc2O)C=C1COC(=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.369
CB1 binding score: -15.111
InChIKey:AADYVINFVFLYPF-UHFFFAOYSA-N
ID: 44812
SMILES:C(CCCC)c1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 44813
SMILES:O1c2cc(CCCCC)cc(O)c2C2CC(C)(O1)C1C2C(C)(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -15.411
InChIKey:KIJRWOUBCKIFRA-UHFFFAOYSA-N
ID: 44814
SMILES:C(CCCC)c1cc(O)c(C2C=C(C)CCC2C(=C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N