ID: 45193
SMILES:O(C)c1cc(C=O)ccc1C1C=C(C)CCC1C(C)=C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 270.372
CB1 binding score: -18.625
InChIKey:GYIHBOAOMZBFAW-UHFFFAOYSA-N
ID: 45194
SMILES:c1(OC)c(O)c(CCCCC)cc2c1c1ccc(C)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.463
CB1 binding score: -17.04
InChIKey:QDTXVYHXQWWVBA-UHFFFAOYSA-N
ID: 45195
SMILES:c12c(c(O)cc(CCCCC)c1)C1C(CC=C(C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 45196
SMILES:c1(C(CC)C)c(O)c2c3c(cc(C)c2O)OC2(C)C(C3C(C)(C)C2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -17.581
InChIKey:KDCRFXAXWMNDJT-UHFFFAOYSA-N
ID: 45197
SMILES:O=C1C2C(CCC3(C)Oc4c(O)cc(CCCCC)cc4C=C23)C(C)(C)C2CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 448.647
CB1 binding score: -15.367
InChIKey:QWZQUCKXZCKHAQ-UHFFFAOYSA-N
ID: 45198
SMILES:O(CC)c1c(CC)c2c(c(CC=C(C)C)c1)OC(C)(C)C1CC=C(C(OC)=O)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.57
CB1 binding score: -13.466
InChIKey:YXUDCGNLZNOJHB-UHFFFAOYSA-N
ID: 45199
SMILES:CC1(C)C2CC3c4c(cc(CCCCC)cc4O)OC(C)(C)C3CC2(CO)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.548
CB1 binding score: -15.087
InChIKey:LQVTXSXTTNFCOT-UHFFFAOYSA-N
ID: 45200
SMILES:c1(CCCCC)cc2c(c(O)c1)C1C(C(O)(C)C)CCC(C)(O2)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -16.499
InChIKey:XREAGBGXAPWDDD-UHFFFAOYSA-N
ID: 45201
SMILES:C1(C)(C)C2C(C=C(C)CC2)c2c(cccc2)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 228.335
CB1 binding score: -18.438
InChIKey:CBEWCUWSPDDHMI-UHFFFAOYSA-N
ID: 45202
SMILES:C(C(=CCCC(C)=CCc1c(O)cc(CCc2ccc(O)cc2)cc1O)C)CC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 434.62
CB1 binding score: -19.427
InChIKey:VVBVATXKSUVSTB-UHFFFAOYSA-N
ID: 45203
SMILES:C(Cc1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2)=CC(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 324.464
CB1 binding score: -17.15
InChIKey:SUFVDOLXOZAZGK-UHFFFAOYSA-N
ID: 45204
SMILES:C(=C(C)C)C(=O)CC1(C)Oc2c(c(O)cc(CCCCC)c2)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -18.08
InChIKey:YZVYCRWDYYGBRC-UHFFFAOYSA-N
ID: 45205
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: 45206
SMILES:C(CCC)c1cc(O)c2c(c1O)C1CC(C)(O2)C2CC(OC)C(C)(C)OC2C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.52
CB1 binding score: -16.82
InChIKey:BFCOGNKPUXWOIZ-UHFFFAOYSA-N
ID: 45207
SMILES:C1CCC2(C(CO)=C)c3c(cc(CCCCC)cc3O)OC(C)(CC2)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -13.748
InChIKey:FLIMDCGUUYRKDG-UHFFFAOYSA-N
ID: 45208
SMILES:C(CCc1cc(O)c(Cl)c(O)c1)C(C)(C=C)O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 256.729
CB1 binding score: -14.813
InChIKey:UROGYTCBRLQNDY-UHFFFAOYSA-N
ID: 45209
SMILES:CC12C3=C(C(C)(C)CC1)C(=O)C=C(C)C3C(O)c1c(cc(CO)cc1O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.445
CB1 binding score: -15.929
InChIKey:YUPSUEQPNZOCFX-UHFFFAOYSA-N
ID: 45210
SMILES:C1(O)C(C(C)C)CCC(C)C12Oc1c(c(OC)cc(CCCCCC)c1)C2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.548
CB1 binding score: -13.486
InChIKey:SNOZYOKBWQENNG-UHFFFAOYSA-N
ID: 45211
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)C2C=C(C(O)=O)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -20.052
InChIKey:YOVRGSHRZRJTLZ-UHFFFAOYSA-N
ID: 45212
SMILES:C1(C)=CC2C(C(C)(C)Oc3cc(CCCCC)c(COC(=O)CCC)c(C=O)c32)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.597
CB1 binding score: -17.033
InChIKey:BTSPWGCJNKMTLQ-UHFFFAOYSA-N
ID: 45213
SMILES:CC(CCC=C(C)C)=CCc1c(O)c(C(=O)O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Aromatic polyketides
Class: Cannabinoids;Catechols with side chains
MW: 344.495
CB1 binding score: -19.654
InChIKey:TURBAOCYHPEVOM-UHFFFAOYSA-N