ID: 25516
SMILES:c12cc(CCCCC)c(C(O)=O)c(O)c1C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -19.351
InChIKey:UCONUSSAWGCZMV-UHFFFAOYSA-N
ID: 25517
SMILES:C12=C(CC=CC1)C(C)(C)Oc1c2c(O)c(Br)c(C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 321.214
CB1 binding score: -15.706
InChIKey:WSUAZQXAKACRKL-UHFFFAOYSA-N
ID: 25518
SMILES:CC1(C)Oc2cc(CCC)cc(O)c2C2C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.321
InChIKey:ZROLHBHDLIHEMS-UHFFFAOYSA-N
ID: 25519
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C1CCC(C)=C1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.236
InChIKey:ISFJBVDYHLICJJ-UHFFFAOYSA-N
ID: 25520
SMILES:CCc1cc(O)c2c(c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -18.957
InChIKey:JJBMVXFZSLTKCL-UHFFFAOYSA-N
ID: 25521
SMILES:c1c(C)cc(O)c2c1OC1(C2(C)C)CC(C)CC1=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.333
CB1 binding score: -16.166
InChIKey:GHACWRKTNGUTJS-UHFFFAOYSA-N
ID: 25522
SMILES:CCCCCCc1c(C)cc2c(c1O)C1CC(C)(O2)CCC1C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -14.958
InChIKey:MPRDHLLHUAPMJD-UHFFFAOYSA-N
ID: 25523
SMILES:C1(O)C(C)=CC2C(C(C)(C)Oc3cc(C)c(O)cc32)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -12.741
InChIKey:UGPGDTIQQMMRCQ-UHFFFAOYSA-N
ID: 25524
SMILES:C(CCl)C1C=C2c3c(O)c(C(=O)O)c(CCCCC)cc3OC(C)(C)C2CC(=O)C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 448.987
CB1 binding score: -16.385
InChIKey:WOEZWFRMGIHUPV-UHFFFAOYSA-N
ID: 25525
SMILES:CC1=CCCC(C)(C)CC(c2c(O)cc(CCCCC)cc2O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -14.142
InChIKey:MWLHIZWQTCVOIU-UHFFFAOYSA-N
ID: 25526
SMILES:C(Cc1cc(O)c(CC=C(CCC=C(C)C)C)c(OC)c1)CN
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 317.473
CB1 binding score: -15.374
InChIKey:ZMADSOGQRRWXII-UHFFFAOYSA-N
ID: 25527
SMILES:C(C)CCc1c(C2C(C(=C)C)CCC(C)=C2)c(O)ccc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -16.271
InChIKey:XDUFIYJWFJJPSI-UHFFFAOYSA-N
ID: 25528
SMILES:C(CCC)Cc1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 25529
SMILES:C12C3OC3C(C)CC1c1c(O)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -16.474
InChIKey:VKCYDTZQIMVEOU-UHFFFAOYSA-N
ID: 25530
SMILES:OC1C2(C)CC3c4c(cc(CCCCC)cc4O)OC(C)(CO)C(C3C1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -15.031
InChIKey:VNDAARCCGCMPMB-UHFFFAOYSA-N
ID: 25531
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)C1C2C(O)C(O)(C)CC1)(O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 350.455
CB1 binding score: -15.35
InChIKey:WFJOZCZSFCEVDL-UHFFFAOYSA-N
ID: 25532
SMILES:Oc1ccc2c(c1C)C1C(C(CO)(C)O2)CCC(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -14.818
InChIKey:XLEHRZFBKXFPLZ-UHFFFAOYSA-N
ID: 25533
SMILES:C1C(C(C)C)C(c2c(O)cc(CCC)cc2O)CC(C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.447
CB1 binding score: -19.319
InChIKey:VNFNICPIQJPBJY-UHFFFAOYSA-N
ID: 25534
SMILES:CC1=CC2c3c(O)cc(CCCCC)cc3OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 25535
SMILES:C(C(O)(C)C)Cc1c(O)c2c(cc1C)OC(C)(C)C1C2C(O)C(C)CC1OC(C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 420.546
CB1 binding score: -12.681
InChIKey:TWTWOVHMVPDBGF-UHFFFAOYSA-N
ID: 25536
SMILES:CC(=CCc1c(O)cc(CCC)cc1O)CCCC(C1C=C(C)CCC1=C(C)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.642
CB1 binding score: -17.003
InChIKey:CDWFRFIKOVXXON-UHFFFAOYSA-N