ID: 73606
SMILES:CCCCCc1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 73607
SMILES:C(C)(=O)OC1Cc2c(O)cc(CCCCC)cc2OC1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 306.402
CB1 binding score: -16.872
InChIKey:LILVZBSIHBDNJN-UHFFFAOYSA-N
ID: 73608
SMILES:C1=C(C)C2Cc3c(cc(CCCCC)cc3O)OC2(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -17.344
InChIKey:IFCKJYQYQVSTON-UHFFFAOYSA-N
ID: 73609
SMILES:O(CC(=C)C)c1cc2c(cc1O)OC(C)(C)C1C2CC(C)=CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -15.768
InChIKey:FESVUXWZRJWMHZ-UHFFFAOYSA-N
ID: 73610
SMILES:OC(c1c(O)ccc2c1-c1c(O)cc(CCCCC)cc1OC2(C)C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.418
CB1 binding score: -16.341
InChIKey:FPMFCSSYSPDXOS-UHFFFAOYSA-N
ID: 73611
SMILES:c1(C(CCCC(C)C)=C)c2c(c(O)c(C#CC(C)C)c1O)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 436.636
CB1 binding score: -13.479
InChIKey:HYICAAXHBRKBDZ-UHFFFAOYSA-N
ID: 73612
SMILES:Oc1cc(CCCCC)cc2c1C1C=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: 73613
SMILES:C(CC)CCc1cc(O)c2c(c1)OC(C)(C)C1=CC(C)CCC1=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -14.557
InChIKey:APEYRILNNUSSSC-UHFFFAOYSA-N
ID: 73614
SMILES:C1(C)=CCCC2(C)Oc3c(c(O)cc(CCCCCC)c3)C(OC(C)=O)C2C1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.515
CB1 binding score: -13.711
InChIKey:MIFIVKXCFXNZFB-UHFFFAOYSA-N
ID: 73615
SMILES:Oc1cc(CCC)cc2c1C1C(C(C)(C)O2)CCC(CO)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -17.334
InChIKey:BZTCTQCMWCFWBO-UHFFFAOYSA-N
ID: 73616
SMILES:CCCCCc1cc2c(c(O)c1)C1C(CC=C(C)C1)C2(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -17.334
InChIKey:YNNFYMQFHNFBDP-UHFFFAOYSA-N
ID: 73617
SMILES:C(C12C(O)(c3c(cc(CCCCC)cc3O)OC1(C)C)C(=O)C=C(OC)C2=O)=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.443
CB1 binding score: -15.058
InChIKey:NLRLXEWLCBUIQW-UHFFFAOYSA-N
ID: 73618
SMILES:c12c(c(O)cc(CCCCC)c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 73619
SMILES:O(C(=O)C)C1C2C(C)(C)Oc3c(c(O)cc(CCCCC)c3)C2C=C(COC(=O)C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 430.541
CB1 binding score: -16.418
InChIKey:FIIWOLVDOOHTFL-UHFFFAOYSA-N
ID: 73620
SMILES:C1(C)(C)Oc2c(c(OC)cc(CCCCC)c2)C2C1CCC(C)(O)C2O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.51
CB1 binding score: -17.791
InChIKey:WKGFZDRQLNVRRQ-UHFFFAOYSA-N
ID: 73621
SMILES:c1(OC)cc(CCCCC)cc2c1C1C3(O2)C(O)(C(OC)=CC(=O)C3C)C(Cl)C1C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 434.96
CB1 binding score: -15.626
InChIKey:DNKLBYVXLZHZQU-UHFFFAOYSA-N
ID: 73622
SMILES:C1(C)(C)Oc2c(cc(CCCC)cc2O)C2C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -16.879
InChIKey:IXZUQKJFDLWXNQ-UHFFFAOYSA-N
ID: 73623
SMILES:C(CCC)c1cc(OC)c(C2C(C(C)=C)CCC(C)C2)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -17.852
InChIKey:JMFRZRDZKDDBDR-UHFFFAOYSA-N
ID: 73624
SMILES:C(CCc1cc(O)c(C2C=C(C)CCC2C(=C)C)c(O)c1)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -18.609
InChIKey:HAKUWGCTBUVNJQ-UHFFFAOYSA-N
ID: 73625
SMILES:Oc1cc(CCCCC)cc2c1C1C=C(CO)C3CCC2(C)C1(C)CC3
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.534
CB1 binding score: Not available
InChIKey:FKSZOVRSOPWXHV-UHFFFAOYSA-N
ID: 73626
SMILES:c1(CC=C)cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.399
CB1 binding score: -18.166
InChIKey:FGEQAFJXCIBXCD-UHFFFAOYSA-N