ID: 55903
SMILES:CCCCCc1cc(O)c2c(c1)OC(c1c(O)ccc(C)c1)C(C(C)C)(O)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.516
CB1 binding score: -15.588
InChIKey:MDDXNIHBDRHDRD-UHFFFAOYSA-N
ID: 55904
SMILES:C1C(CC=C(C)C)(C)C(c2c(O)c(C(O)=O)c(CCCCC)cc2O)CC(O)(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 418.574
CB1 binding score: Not available
InChIKey:IXABOOGUOPETAH-UHFFFAOYSA-N
ID: 55905
SMILES:C1CC2(C)c3c(O)cc(CCCCC)cc3OC1(C)CCC2C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.539
CB1 binding score: -12.129
InChIKey:OJICMYJBJRHMFB-UHFFFAOYSA-N
ID: 55906
SMILES:O(C)c1c(-c2ccccc2OC)cc2c(c1OC(C)=O)OC(C)(C)C1CCC(C)=CC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 422.521
CB1 binding score: -14.57
InChIKey:ATGNGIGJPUWBBG-UHFFFAOYSA-N
ID: 55907
SMILES:C1C2C(C)CC=C2C(C)(C)Oc2c(c(O)cc(CCCCCC)c2)C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.55
CB1 binding score: -16.51
InChIKey:XMIQUIGVSFDVFN-UHFFFAOYSA-N
ID: 55908
SMILES:OCC(=O)c1c(CCCCC)cc(OC)c2c1OC(C)(C)C(O)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 336.428
CB1 binding score: -15.731
InChIKey:DZGBUYDDNXPMSY-UHFFFAOYSA-N
ID: 55909
SMILES:CC1=CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 55910
SMILES:c1(O)c2c(cc(CCC)c1)OC(C)(C)C1=CCC(C)C(=O)C12O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.397
CB1 binding score: -14.908
InChIKey:ZECGEZOPFAKQHO-UHFFFAOYSA-N
ID: 55911
SMILES:C1C(C)CC(=O)C2C(C)(C)Oc3c(c(O)c(CC=C(C)C)c(OC(=O)C)c3)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.488
CB1 binding score: -14.251
InChIKey:KRHIDBVEGZJAJP-UHFFFAOYSA-N
ID: 55912
SMILES:C(CCC)Cc1cc2c(c(O)c1)C1C3(O2)CCCC(C)C1(C)CCC(C)=C3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.561
CB1 binding score: -15.588
InChIKey:JODRKFZQCDZZQJ-UHFFFAOYSA-N
ID: 55913
SMILES:C(c1cc(O)c2c(c1)OC1(C)C(C2)CC(O)C(C(C)C)=C1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -14.614
InChIKey:BMPSSOZDXWJAQS-UHFFFAOYSA-N
ID: 55914
SMILES:C(C(=O)c1c(O)cc(O)c2c1OC(C)(C)C1CCC(C)=CC21)(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.408
CB1 binding score: -17.913
InChIKey:HQHBQGWPGPDZNC-UHFFFAOYSA-N
ID: 55915
SMILES:c1(CC=C)cc(O)c2c(c1)OC(C)(C)C1(CC=C(C)CC1)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.426
CB1 binding score: -16.171
InChIKey:ZJRSSDJSNHEJDS-UHFFFAOYSA-N
ID: 55916
SMILES:C12C(C)(C)C1C(O)C(C)C(=O)C1c3c(cc(CCCCC)cc3O)OC(C)(C)C1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.586
CB1 binding score: -16.998
InChIKey:OWANTBQKDZFXLR-UHFFFAOYSA-N
ID: 55917
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C1C2CC(=C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.055
InChIKey:AOYYFUGUUIRBML-UHFFFAOYSA-N
ID: 55918
SMILES:C1C(C)=CCCC(C)Cc2c(O)cc(CCCCC)cc21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.459
CB1 binding score: -15.432
InChIKey:WPYFPHBUNGQSPL-UHFFFAOYSA-N
ID: 55919
SMILES:c12c(C=O)c(O)cc(CCCCC)c1OC1(C)C(CC(C)(C)CC1)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -15.476
InChIKey:FVWPIVQARLVTSR-UHFFFAOYSA-N
ID: 55920
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C1C2=CC(C)(O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -18.296
InChIKey:FZAGTOJLWTUWJG-UHFFFAOYSA-N
ID: 55921
SMILES:C(Cc1c(C)c(O)c2c(c1)OC(C)(C)C1CC=C(C)CC12)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.507
CB1 binding score: -14.275
InChIKey:BLSNTUXVAPFHIE-UHFFFAOYSA-N
ID: 55922
SMILES:C12=CC(=O)C3C(C)(C1CCC1(C)C2c2c(OC(C)=O)cc(CCCCC)cc2O1)CCC(OC(C)=O)C3(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 536.709
CB1 binding score: -13.649
InChIKey:MHWYOKAORXRZPI-UHFFFAOYSA-N
ID: 55923
SMILES:C(Cc1cc(O)c(C2C=C(C)CCC2C(=C)C)c(O)c1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.532
InChIKey:REOZWEGFPHTFEI-UHFFFAOYSA-N