ID: 89041
SMILES:C(Cc1cc2c(c(OC)c1OC)OC(C)(C)C1C2C=C(C)CC1)=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -15.947
InChIKey:BWMJECFPUUOLRS-UHFFFAOYSA-N
ID: 89042
SMILES:CC1(O)CC(O)C2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.51
CB1 binding score: -15.138
InChIKey:OEHVJJWLDCHJFS-UHFFFAOYSA-N
ID: 89043
SMILES:c1(CCC(CCC)C=C)cc(O)c(C2C(C(C)C)CCC(C)=C2)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.55
CB1 binding score: Not available
InChIKey:WSTLTELNFHWDEK-UHFFFAOYSA-N
ID: 89044
SMILES:c12c(cc(CCCCC)cc1O)OC1(CC(=O)C(=C(C)C)CC1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -13.899
InChIKey:AFHTWJHTJBBPFJ-UHFFFAOYSA-N
ID: 89045
SMILES:c1(CCCCC)cc2c(c(O)c1)C1CC(C)(O2)CCC1C(O)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -17.841
InChIKey:UKPNRAMYBFBWKV-UHFFFAOYSA-N
ID: 89046
SMILES:C(Cc1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1O)C=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.397
CB1 binding score: -17.041
InChIKey:HSNYOFCWKRYZCQ-UHFFFAOYSA-N
ID: 89047
SMILES:CC1(C)Oc2c(c(OC)cc(OC)c2C=O)C2C=C(C)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.397
CB1 binding score: -18.498
InChIKey:UXPHYNNAYCPSQV-UHFFFAOYSA-N
ID: 89048
SMILES:c12cc(CCCCC)cc(O)c1OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -19.438
InChIKey:NKPBIUKTNLMNFS-UHFFFAOYSA-N
ID: 89049
SMILES:C1(=O)C(c2c(O)cc(CCCCC)cc2)C2C(=C)C(=O)CC1C2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.463
CB1 binding score: -19.155
InChIKey:GVHIDJXKCVTSKR-UHFFFAOYSA-N
ID: 89050
SMILES:CC1C2(Oc3c(c(O)cc(CCC)c3)C2)C(O)CC(COC(=O)CCC(O)=O)(O)C1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 438.473
CB1 binding score: -13.569
InChIKey:LPGIVSDFVDVMAZ-UHFFFAOYSA-N
ID: 89051
SMILES:c1(C)c(O)cc2c(c1CC=C(C)C)OC(C)(C)C1C2CC(C)=CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -15.761
InChIKey:FCHUQDJFFCJKLI-UHFFFAOYSA-N
ID: 89052
SMILES:O1C(=O)C2(CC=O)C1c1c(O)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.396
CB1 binding score: -13.521
InChIKey:FZMVPIZOIGLEDB-UHFFFAOYSA-N
ID: 89053
SMILES:C1(C)=CC(c2ccc(CCCCC)cc2)C(C(C)C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.487
CB1 binding score: -19.108
InChIKey:KCGRQTUOQYSEJY-UHFFFAOYSA-N
ID: 89054
SMILES:C(c1cc(O)c2c(c1)OC(C)(C)c1c-2cc(C)cc1)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 296.41
CB1 binding score: -19.327
InChIKey:GGVVJZIANMUEJO-UHFFFAOYSA-N
ID: 89055
SMILES:O(C(=O)C)CC(CCc1cc2c(c(O)c1)C1C(CC2)C(C)(C)O1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -15.178
InChIKey:SZSZOXXEDKMBEM-UHFFFAOYSA-N
ID: 89056
SMILES:C12CC(C)=CCC3C(C)(C)Oc4cc(CCCCC)cc(O)c4C3C1(O)C(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.614
CB1 binding score: -16.957
InChIKey:LPQBTSQFWKGKPD-UHFFFAOYSA-N
ID: 89057
SMILES:c12cc(C)cc(O)c1-c1c(cc(CCCCC)cc1O)OC(C)(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.463
CB1 binding score: -15.929
InChIKey:AIXQZLDXOGQSDM-UHFFFAOYSA-N
ID: 89058
SMILES:C1C(C)=CC(c2ccc(CCCCC)cc2)C(C(C)(C)O)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.486
CB1 binding score: -18.046
InChIKey:MXECOWWPQRFPTG-UHFFFAOYSA-N
ID: 89059
SMILES:c12c(OC)cc(CCCCCC)cc1c1c(c(O)c2C=O)OC(CCC=C(CCC=C(C)C)C)(C)C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 504.711
CB1 binding score: -16.471
InChIKey:BPVKRYSINHRXMX-UHFFFAOYSA-N
ID: 89060
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)C1=C2C(O)C(O)(C)CC1)(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -16.491
InChIKey:XKIGLPFZAYBQRA-UHFFFAOYSA-N
ID: 89061
SMILES:O1c2cc(CCCCC)cc(O)c2C2C3C1(CCC3C(=C)C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -17.406
InChIKey:OTVJGSQFKVXVOK-UHFFFAOYSA-N