ID: 63904
SMILES:C1(C)=CC(c2c(O)ccc(O)c2)C(C(C)(CCC=C(C)C)OC)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -15.417
InChIKey:GOYPRJRDAYDXNP-UHFFFAOYSA-N
ID: 63905
SMILES:C1C(C(C)C)CCC2(C)Oc3c(c(O)cc(CCCCC)c3)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -18.855
InChIKey:VBMSTUJNROPVAW-UHFFFAOYSA-N
ID: 63906
SMILES:C1(C)=CC(c2ccc(CCCCC)cc2)C(C(=C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 282.471
CB1 binding score: -19.804
InChIKey:VGBLUPCGCQUYRW-UHFFFAOYSA-N
ID: 63907
SMILES:C1(C)C2(C)Cc3c(O)c(C(OC)=O)c(CCCCC)cc3OC2(C)C=CC1CCC(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 442.64
CB1 binding score: -14.404
InChIKey:DWKJJEMXSHYFAD-UHFFFAOYSA-N
ID: 63908
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C1C2C=C(CCC=C(C)CO)C(=O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.542
CB1 binding score: -16.502
InChIKey:XBOJXUQGFIJCEM-UHFFFAOYSA-N
ID: 63909
SMILES:C1(C)(C)C2CCC(C)=CC2c2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 63910
SMILES:O(CC1(C)C2CC=C(C)CC2c2c(cc(C(C)(CCCC(C)C)O)cc2O)O1)C(C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 430.585
CB1 binding score: -14.165
InChIKey:XFMAUJZNYZBNIP-UHFFFAOYSA-N
ID: 63911
SMILES:C1C(C)C(O)=C(CCCCCCc2c(O)c(CC=C(CCC=C(C)C)C)c(O)c(O)c2)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 444.612
CB1 binding score: -16.217
InChIKey:LFTPPQAWCWWWHK-UHFFFAOYSA-N
ID: 63912
SMILES:C(C)(C)=CCCC(C)=CCc1c(O)cc2c(c1OC)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.598
CB1 binding score: -16.312
InChIKey:BUIBNCKRQMBFNY-UHFFFAOYSA-N
ID: 63913
SMILES:COc1c(C2C(C(=C)C)C(c3c(O)cc(CCCCCO)cc3OC)CC(C)=C2)cccc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 450.619
CB1 binding score: -13.131
InChIKey:ZLTSAVOABVYSTK-UHFFFAOYSA-N
ID: 63914
SMILES:O=C(C)Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -19.106
InChIKey:DEWSJDIJFWQLOA-UHFFFAOYSA-N
ID: 63915
SMILES:CC1C2=C(c3c(cc(CCCCC)cc3O)O1)C=CC(C)(C)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -15.929
InChIKey:OBOOGCNAMDAYIJ-UHFFFAOYSA-N
ID: 63916
SMILES:C(CCC)Cc1cccc(C2C(C(C)=C)CCC(O)(CO)C=C2)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -15.929
InChIKey:PTUTVEWOPTVAOL-UHFFFAOYSA-N
ID: 63917
SMILES:C(=C)(C1CCC(C)=CC1c1c(O)cc(CCCC(O)CCCc2ccoc2)cc1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 424.581
CB1 binding score: -17.178
InChIKey:XSTAMWPJBZLGLR-UHFFFAOYSA-N
ID: 63918
SMILES:C1CC2C(C)(C)Oc3c(c(O)cc(CCCCC)c3)C2C=C1C(=O)OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -17.943
InChIKey:CCMWHLPOQSRJEP-UHFFFAOYSA-N
ID: 63919
SMILES:CNCc1cc(O)c2c(c1O)OC(C)(C)C1CCC(C)=CC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 303.402
CB1 binding score: -17.019
InChIKey:CQLNPHMURRVGSV-UHFFFAOYSA-N
ID: 63920
SMILES:CC(C)=CCCC1(C)Oc2c(c(O)cc(CCCCC)c2)CC1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -19.002
InChIKey:ITDDKOGKAGSKEJ-UHFFFAOYSA-N
ID: 63921
SMILES:c1(C(OC2C3C(C)(CC=C(C)C2)Oc2c(c(O)cc(CCCCC)c2)C3C(C)=C)=O)ccc(O)c(OC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 520.666
CB1 binding score: -16.094
InChIKey:WZFCPXXRDOSLOI-UHFFFAOYSA-N
ID: 63922
SMILES:C(=O)(C)Oc1c2c(c3c(c1)C(=O)OC3)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.391
CB1 binding score: -14.433
InChIKey:YNNYNVRQYSABMG-UHFFFAOYSA-N
ID: 63923
SMILES:C(=CC(c1c2c(c(O)c(C(C)(C)CCCCC)c1)OC(C)(C)C1CCC(C)(O)C(O)C12)=O)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 472.666
CB1 binding score: Not available
InChIKey:QAZWRPTUCHOXFD-UHFFFAOYSA-N
ID: 63924
SMILES:C(CCCC)c1cc(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